N-[(2S)-3-[cyclopentylmethyl(pyridin-2-ylsulfonyl)amino]-2-oxidanyl-propyl]-N-phenethyl-benzamide

Systemtic Name: N-[(2S)-3-[cyclopentylmethyl(pyridin-2-ylsulfonyl)amino]-2-oxidanyl-propyl]-N-phenethyl-benzamide Openeye Name: N-[(2S)-3-[cyclopentylmethyl(2-pyridylsulfonyl)amino]-2-hydroxy-propyl]-N-phenethyl-benzamide CAS Name: N-[(2S)-3-[cyclopentylmethyl(2-pyridinylsulfonyl)amino]-2-hydroxypropyl]-N-phenethylbenzamide IUPAC Name: N-[(2S)-3-[cyclopentylmethyl(pyridin-2-ylsulfonyl)amino]-2-hydroxypropyl]-N-phenethylbenzamide Traditional Name: N-[(2S)-3-[cyclopentylmethyl(2-pyridylsulfonyl)amino]-2-hydroxy-propyl]-N-phenethyl-benzamide Formula: C29H35N3O4S MolecularWeight: 521.6709

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)CN(CC(CN(CCC2=CC=CC=C2)C(=O)C3=CC=CC=C3)O)S(=O)(=O)C4=CC=CC=N4

Isomeric SMILES

C1CCC(C1)CN(C[C@H](CN(CCC2=CC=CC=C2)C(=O)C3=CC=CC=C3)O)S(=O)(=O)C4=CC=CC=N4

InChI

InChI=1S/C29H35N3O4S/c33-27(23-32(21-25-13-7-8-14-25)37(35,36)28-17-9-10-19-30-28)22-31(20-18-24-11-3-1-4-12-24)29(34)26-15-5-2-6-16-26/h1-6,9-12,15-17,19,25,27,33H,7-8,13-14,18,20-23H2/t27-/m0/s1